1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-methoxyphenoxy)ethanone

Systemtic Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-methoxyphenoxy)ethanone Openeye Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]-2-(2-methoxyphenoxy)ethanone CAS Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]-2-(2-methoxyphenoxy)ethanone IUPAC Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-methoxyphenoxy)ethanone Traditional Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]-2-(2-methoxyphenoxy)ethanone Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)N2CCCC(C2)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)N2CCC[C@@H](C2)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H26N2O5/c1-26-18-6-2-3-7-19(18)29-15-22(25)24-10-4-5-17(14-24)23-16-8-9-20-21(13-16)28-12-11-27-20/h2-3,6-9,13,17,23H,4-5,10-12,14-15H2,1H3/t17-/m0/s1